N-[(1S)-2-(Dimethylamino)-1-Phenylethyl]-6,6-Dimethyl-3-[(2-Methylthieno[3,2-D]Pyrimidin-4-Yl)Amino]-4,6-Dihydropyrrolo[3,4-C]Pyrazole-5(1H)-Carboxamide
Properties
Property | Value |
---|---|
Formula | C25H30N8OS |
IUPAC Name | n-[(1s)-2-(dimethylamino)-1-phenyl-ethyl]-6,6-dimethyl-3-[(2-methylthieno[3,2-d]pyrimidin-4-yl)amino]-1,4-dihydropyrrolo[3,4-c]pyrazole-5-carboxamide |
Molecular Mass | 490.624 g·mol−1 |
Heat of Formation | 390.3 ± 16.7 kJ·mol−1 |
Dipole Moment | 4.45 ± 1.08 D |
Volume | 589.53 Å 3 |
Surface Area | 501.45 Å 2 |
HOMO Energy | -8.38 ± 0.55 eV |
LUMO Energy | -0.81 ± eV |
Point Group Symmetry | C1 |
InChIKey | AYCPARAPKDAOEN-LJQANCHMSA-N |
QR Code | Generate QR Code |
Links | PubChem ChemSpider |
DOI | |
Downloads | Get JSON data Get MOL2 data Get SVG Image |
Elements | H S C O N |